4-Chlorobenzylzinc chloride solution
Product Information
Molecular Formula
ClC6H4CH2ZnCl
Molecular Weight
226.42
Description
4-Chlorobenzylzinc chloride solution is a vital component in the biomedical industry, used for the development of drugs aiming to treat various diseases. With its unique properties, this solution plays a crucial role in the synthesis of pharmaceutical compounds for conditions such as cancer, inflammation, and microbial infections.
Synonyms
1-chloro-4-methanidylbenzene; chlorozinc(1+); 4-chlorobenzylzinc chloride; 4-Chlorobenzylzinc chloride 0.5 M in Tetrahydrofuran; 4-Chlorobenzylzinc chloride,0.5m soluti onin tetrahydrofuran; 4-Chlorobenzylzinc chloride, 0.5M in THF, packaged under Argon in resealable ChemSeal bottles
IUPAC Name
1-chloro-4-methanidylbenzenechlorozinc(1+)
SMILES
[CH2-]C1=CC=C(C=C1)Cl.Cl[Zn+]
InChI
InChI=1S/C7H6Cl.ClH.Zn/c1-6-2-4-7(8)5-3-6/h2-5H,1H21H/q-1+2/p-1
InChI Key
GIUOJMHOGPURPS-UHFFFAOYSA-M
Flash Point
1.4 °F - closed cup
Density
0.96 g/mL at 25 °C
Storage
2-8°C
Safety Information
Hazards
H225 - H302 - H314 - H335 - H351
Precautionary Statement
P210 - P260 - P280 - P305 + P351 + P338 - P370 + P378 - P403 + P235
Computed Properties
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
0
Exact Mass
223.913797 g/mol
Monoisotopic Mass
223.913797 g/mol
Topological Polar Surface Area
0Ų
Heavy Atom Count
10
Formal Charge
0
Complexity
70
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
2
Compound Is Canonicalized
Yes
